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Barbacarpan

Barbacarpan structure

CAS No:
213912-46-0
Formula:
C20H18O4
Chemical Name:
Barbacarpan
Synonyms:
Barbacarpan;1,2,5b(5bR,11bR)-11b-Tetrahydro-2-(1-methylethenyl)-6H-furo[2',3':6,7]benzofuro[3,2-c][1]benzopyran-9-ol
Categories:
Natural Products > Phenols

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Barbacarpan Basic Attributes

Molecular Weight：

322.4

Exact Mass：

322.120514

Characteristics

PSA：

47.92000

XLogP3：

3.93

Density：

1.3±0.1 g/cm3

Boiling Point：

467.3±45.0 °C at 760 mmHg

Flash Point：

236.4±28.7 °C

Refractive Index：

1.639

Computed Properties

Molecular Weight:322.4
XLogP3:3.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:322.12050905
Monoisotopic Mass:322.12050905
Topological Polar Surface Area:47.9
Heavy Atom Count:24
Complexity:520
Defined Atom Stereocenter Count:2
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes